4-(N,N-dimethylamino)benzonitrile

CAS:
Other names: DMABN
SMILES: CN(C)c1ccc(cc1)C#N

Properties

MW HBA HBD LogP TPSA Rot. Comp. Fsp3C Brutto formula
146.19 2 0 1.62 27.03 1 32 0.22 C9H10N2

Availability

Suppliers Supplier IDs Storage Storage ID Quantity Class Added
JN_361 None Jan. 1, 2023

Bar codes

Plate barcode Sample barcode

PAINS

Identified PAINS
Not checked

Supramolecules

Namelog KSDpHT(°C)MethodRef
[a-Cyclodextrin](1).[4-(N,N-dimethylamino)benzonitrile] -0.28 -2.00 25.0 fluorescence spectroscopy Edwin Quinones 1999
[b-Cyclodextrin](1).[4-(N,N-dimethylamino)benzonitrile] 1.01 -0.15 25.0 fluorescence spectroscopy Edwin Quinones 1999
[b-Cyclodextrin](1).[4-(N,N-dimethylamino)benzonitrile] 0.66 20.0 fluorescence spectroscopy Edwin Quinones 1999
[b-Cyclodextrin](1).[4-(N,N-dimethylamino)benzonitrile] 0.62 28.0 fluorescence spectroscopy Edwin Quinones 1999
[b-Cyclodextrin](1).[4-(N,N-dimethylamino)benzonitrile] 0.74 31.0 fluorescence spectroscopy Edwin Quinones 1999
[b-Cyclodextrin](1).[4-(N,N-dimethylamino)benzonitrile] 0.54 34.0 fluorescence spectroscopy Edwin Quinones 1999
[b-Cyclodextrin](1).[4-(N,N-dimethylamino)benzonitrile] 0.69 37.0 fluorescence spectroscopy Edwin Quinones 1999
[b-Cyclodextrin](1).[4-(N,N-dimethylamino)benzonitrile] 0.54 40.0 fluorescence spectroscopy Edwin Quinones 1999
[b-Cyclodextrin](1).[4-(N,N-dimethylamino)benzonitrile] 0.70 43.0 fluorescence spectroscopy Edwin Quinones 1999
[b-Cyclodextrin](1).[4-(N,N-dimethylamino)benzonitrile] 0.74 47.0 fluorescence spectroscopy Edwin Quinones 1999
[b-Cyclodextrin](1).[4-(N,N-dimethylamino)benzonitrile] 0.60 51.0 fluorescence spectroscopy Edwin Quinones 1999
[b-Cyclodextrin](1).[4-(N,N-dimethylamino)benzonitrile] 0.47 56.0 fluorescence spectroscopy Edwin Quinones 1999
[b-Cyclodextrin](1).[4-(N,N-dimethylamino)benzonitrile] 0.55 61.0 fluorescence spectroscopy Edwin Quinones 1999
[b-Cyclodextrin](1).[4-(N,N-dimethylamino)benzonitrile] 3.01 2.40 25.0 Edwin Quinones 1999
Comment